SCHEMBL18834945

SCHEMBL18834945

CCc1ccccc1Oc1nc2c(n1Cc1ccc(Cl)cc1)C(=O)N(CCCO)C(O)N2C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPC4 Q9UBN4 2/20 0.39
▸ TRPC5 Q9UL62 2/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ TRPC1 P48995 1/20 0.36
▸ P2RX3 P56373 15/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ PDE5A O76074 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19375436 0.93 P2RX7 (0.35) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL18834254 0.91 TRPC4 (0.40) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505503 0.90 TRPC4 (0.39) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL18834366 0.88 TRPC5 (0.38) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505572 0.88 TRPC4 (0.47) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL18834916 0.87 TRPC4 (0.45) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL18833918 0.85 P2RX3 (0.35) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19374906 0.85 TRPC5 (0.49) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19374881 0.85 P2RX3 (0.44) TRPC4TRPC5KCNH2P2RX3TP53
SCHEMBL19375611 0.85 TRPC4 (0.41) TRPC4TRPC5KCNH2TRPC1P2RX3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970303-B1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-05-10 — — EP disclosed
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